Geometry & MOs

Info

ID:	235072
PubChem CID:	92303988
Reduced:	FSN2O2H21C24 (1)
Stoich.:	ABC2D2E21F24 (1)
Weight, g/mol:	424.218449
ΔH_f, kcal/mol:	-66.98
Dipole, Da:	2.36
IP(EA), eV:	-9.08(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-ethyl-N-[4-[(2R)-3-(3-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]hexanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NC2=CC=CC(=C2)[C@H]3N(C(=O)CS3)C4=C(C(=CC=C4)F)C

DOS

IR

Vibrations